SCHEMBL23745812

SCHEMBL23745812

Cc1cccc(C(CCNC2CCC(N)CC2)c2cn(CC3CCNCC3)c3ccccc23)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SOS1 Q07889 2/20 0.42
MPO P05164 10/20 0.34
ICMT O60725 1/20 0.33
MAPT P10636 2/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC6A4 P31645 1/20 0.31
HDAC1 Q13547 1/20 0.30
HDAC8 Q9BY41 1/20 0.30
HDAC6 Q9UBN7 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL23721995 0.99 SOS1 (0.41) SOS1MPOICMTMAPTMEN1
SCHEMBL23745514 0.94 SOS1 (0.48) SOS1MPOICMTMAPTMEN1
SCHEMBL23745678 0.93 MPO (0.37) SOS1MPOICMTMAPTMEN1
Hydrochloric Acid SCHEMBL23722018 0.92 MPO (0.36) SOS1MPOICMTMAPTMEN1
SCHEMBL23745691 0.92 CNR1 (0.38) SOS1MPOICMTMAPTMEN1
SCHEMBL23745690 0.92 CNR1 (0.38) SOS1MPOICMTMAPTMEN1
SCHEMBL23745852 0.92 CNR1 (0.38) SOS1MPOICMTMAPTMEN1
Hydrochloric Acid SCHEMBL23721956 0.91 CNR1 (0.37) SOS1MPOICMTMAPTMEN1
Hydrochloric Acid SCHEMBL23722162 0.91 CNR1 (0.37) SOS1MPOICMTMAPTMEN1
SCHEMBL23745636 0.90 SOS1 (0.48) SOS1MPOICMTMAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF BIOIMICS AB (SE) 2021-08-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210246115-A1 ANTI-INFECTIVE HETEROCYCLIC COMPOUNDS AND USES THEREOF FDPS, FPR1, F12 SOS1 2902/4885MPO 17/4885ICMT 345/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.